| 11 |
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|
| 12 |
|
|
| 13 |
|
#ifdef PROFILE |
| 14 |
< |
#include "mdProfile.hpp" |
| 14 |
> |
#include "profiling/mdProfile.hpp" |
| 15 |
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#endif |
| 16 |
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|
| 17 |
< |
#include "simError.h" |
| 18 |
< |
#include "ForceFields.hpp" |
| 19 |
< |
#include "Atom.hpp" |
| 20 |
< |
#include "fortranWrappers.hpp" |
| 17 |
> |
#include "utils/simError.h" |
| 18 |
> |
#include "UseTheForce/ForceFields.hpp" |
| 19 |
> |
#include "primitives/Atom.hpp" |
| 20 |
> |
//#include "UseTheForce/fortranWrappers.hpp" |
| 21 |
> |
#include "UseTheForce/doForces_interface.h" |
| 22 |
|
|
| 22 |
– |
|
| 23 |
|
void ForceFields::calcRcut( void ){ |
| 24 |
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|
| 25 |
|
#ifdef IS_MPI |
